Water → 4-(4-(4-Cyclopropyl-2,6-dimethylphenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-ylamino)benzonitrile

HRID 1230666

반응식

HRID 1230666 반응식
[Cl:1][c:2]1[n:3][c:4]([O:11][c:12]2[c:13]([CH3:22])[cH:14][c:15]([CH:19]3[CH2:20][CH2:21]3)[cH:16][c:17]2[CH3:18])[c:5]2[c:6]([n:7]1)[cH:8][cH:9][nH:10]2.[F:32][C:33]([F:34])([F:35])[C:36]([OH:37])=[O:38].[NH2:23][c:24]1[cH:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]1.[OH2:39]>>[c:2]1([NH:23][c:24]2[cH:25][cH:26][c:27]([C:28]#[N:29])[cH:30][cH:31]2)[n:3][c:4]([O:11][c:12]2[c:13]([CH3:22])[cH:14][c:15]([CH:19]3[CH2:20][CH2:21]3)[cH:16][c:17]2[CH3:18])[c:5]2[c:6]([n:7]1)[cH:8][cH:9][nH:10]2

참가 물질

5

출처 및 근거

ORD 기록
ord-0a6e0a6fa7ee496493873a7e4dc043e6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

불러오는 중…